John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1ItrJYu7VGn SpectraBase Spectrum ID=7bnfUS149TR

(accessed ).
7-phenyl-5,6,8,9-tetrahydrodibenzo[c,h]xanthylium trifluoromethane sulfonate
SpectraBase Compound ID 1ItrJYu7VGn
InChI InChI=1S/C27H21O.CHF3O3S/c1-2-10-20(11-3-1)25-23-16-14-18-8-4-6-12-21(18)26(23)28-27-22-13-7-5-9-19(22)15-17-24(25)27;2-1(3,4)8(5,6)7/h1-13H,14-17H2;(H,5,6,7)/q+1;/p-1
InChIKey VZLXLZZSHJSCLZ-UHFFFAOYSA-M
Mol Weight 510.53 g/mol
Molecular Formula C28H21F3O4S
Exact Mass 510.111266 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7bnfUS149TR
Name 7-phenyl-5,6,8,9-tetrahydrodibenzo[c,h]xanthylium trifluoromethane sulfonate
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Formula C28H21F3O4S
InChI InChI=1S/C27H21O.CHF3O3S/c1-2-10-20(11-3-1)25-23-16-14-18-8-4-6-12-21(18)26(23)28-27-22-13-7-5-9-19(22)15-17-24(25)27;2-1(3,4)8(5,6)7/h1-13H,14-17H2;(H,5,6,7)/q+1;/p-1
InChIKey VZLXLZZSHJSCLZ-UHFFFAOYSA-M
Instrument Name Varian CFT-20
Sadtler NMR Number 48299M
Solvent DMSO-d6
SpectraBase Batch ID 2wyxKfS2sJ8